\contentsline {part}{I\hspace {1em}使用LAMMPS前你需要知道的基本概念}{3}{part.1}% 
\contentsline {section}{\numberline {1}LAMMPS是什么}{3}{section.1}% 
\contentsline {section}{\numberline {2}盒模型和边界条件}{3}{section.2}% 
\contentsline {section}{\numberline {3}系综}{3}{section.3}% 
\contentsline {section}{\numberline {4}驰豫}{4}{section.4}% 
\contentsline {section}{\numberline {5}步长}{5}{section.5}% 
\contentsline {section}{\numberline {6}势函数}{5}{section.6}% 
\contentsline {section}{\numberline {7}临近表技术}{5}{section.7}% 
\contentsline {section}{\numberline {8}能势能最小化}{6}{section.8}% 
\contentsline {section}{\numberline {9}后续待补充....}{6}{section.9}% 
\contentsline {part}{II\hspace {1em}LAMMPS已知BUG说明}{6}{part.2}% 
\contentsline {section}{\numberline {1}Gama-TiAl驰豫自发出现层错的BUG}{6}{section.1}% 
\contentsline {section}{\numberline {2}周期边界条件下报错原子丢失的BUG（拉伸）}{6}{section.2}% 
\contentsline {section}{\numberline {3}待发现.....}{7}{section.3}% 
\contentsline {part}{III\hspace {1em}常用命令介绍}{7}{part.3}% 
\contentsline {section}{\numberline {4}用来初始化的简单命令}{7}{section.4}% 
\contentsline {subsection}{\numberline {4.1}echo命令}{7}{subsection.4.1}% 
\contentsline {subsection}{\numberline {4.2}units命令}{7}{subsection.4.2}% 
\contentsline {subsection}{\numberline {4.3}dimension命令}{7}{subsection.4.3}% 
